260134

Hyodeoxycholic acid

98%

• Synonym(s): 3α,6α-Dihydroxy-5β-cholan-24-oic acid
• Empirical Formula (Hill Notation): C₂₄H₄₀O₄
• CAS Number: 83-49-8
• Molecular Weight: 392.57
• EC Number: 201-483-2
• MDL number: MFCD00003681
• UNSPSC Code: 12352103

Properties

• assay: 98%
• optical activity: [α]20/D +8.4°, c = 2 in ethanol
• mp: 200-201 °C (lit.)
• SMILES string: C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3C[C@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
• InChI: 1S/C24H40O4/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16+,17-,18+,19+,20+,21+,23-,24-/m1/s1
• InChI key: DGABKXLVXPYZII-SIBKNCMHSA-N